Home Carboxys 2-(4-ethoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid

2-(4-ethoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid

CAS No.:
938312-70-0
Catalog Number:
AG01BGGA
Molecular Formula:
C14H15NO3S
Molecular Weight:
277.3388
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Product Description
Catalog Number:
AG01BGGA
Chemical Name:
2-(4-ethoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid
CAS Number:
938312-70-0
Molecular Formula:
C14H15NO3S
Molecular Weight:
277.3388
MDL Number:
MFCD09714757
IUPAC Name:
2-(4-ethoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C14H15NO3S/c1-3-11-12(14(16)17)19-13(15-11)9-5-7-10(8-6-9)18-4-2/h5-8H,3-4H2,1-2H3,(H,16,17)
InChI Key:
JZUGNACNWOMJGN-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)c1sc(c(n1)CC)C(=O)O
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.077g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.338g/mol
Monoisotopic Mass:
277.077g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties